In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 16 | Yes |
Popular Name: (2S)-1-(diethylamino)-3-[(1-methylcyclopentyl)amino]propan-2-ol (2S)-1-(diethylamino)-3-[(1-meth…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.08 | 4.81 | -97.79 | 4 | 3 | 2 | 41 | 230.396 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 5.38 | -37.09 | 3 | 3 | 1 | 44 | 229.388 | 7 | ↓ |